CID 12523579

774-50-5

Structural Information

Molecular Formula
C9H7FN2S
SMILES
C1=CC(=CC=C1C2=CN=C(S2)N)F
InChI
InChI=1S/C9H7FN2S/c10-7-3-1-6(2-4-7)8-5-12-9(11)13-8/h1-5H,(H2,11,12)
InChIKey
ADOSTLZJKSBUSD-UHFFFAOYSA-N
Compound name
5-(4-fluorophenyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

194.0314 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.03868 135.6
[M+Na]+ 217.02062 146.3
[M-H]- 193.02412 140.5
[M+NH4]+ 212.06522 156.1
[M+K]+ 232.99456 141.8
[M+H-H2O]+ 177.02866 128.3
[M+HCOO]- 239.02960 155.6
[M+CH3COO]- 253.04525 149.6
[M+Na-2H]- 215.00607 138.1
[M]+ 194.03085 134.8
[M]- 194.03195 134.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe